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1-(Hex-1-yn-1-yl)-2-((2-(phenylethynyl)benzyl)oxy)benzene
SpectraBase Compound ID 9yc0QvZv2E7
InChI InChI=1S/C27H24O/c1-2-3-4-8-16-25-17-11-12-19-27(25)28-22-26-18-10-9-15-24(26)21-20-23-13-6-5-7-14-23/h5-7,9-15,17-19H,2-4,22H2,1H3
InChIKey MWEAKKLDMSPMAB-UHFFFAOYSA-N
Mol Weight 364.49 g/mol
Molecular Formula C27H24O
Exact Mass 364.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID oPvaap59B
Name 1-(Hex-1-yn-1-yl)-2-((2-(phenylethynyl)benzyl)oxy)benzene
Appearance White oil
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Exact Mass 364.182715392 u
Formula C27H24O
InChI InChI=1S/C27H24O/c1-2-3-4-8-16-25-17-11-12-19-27(25)28-22-26-18-10-9-15-24(26)21-20-23-13-6-5-7-14-23/h5-7,9-15,17-19H,2-4,22H2,1H3
InChIKey MWEAKKLDMSPMAB-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200984
Molecular Weight 364.488 g/mol
Quality 8
Reported Formula C27H24O
SMILES C(#CCCCC)C1=C(C=CC=C1)OCC1=C(C=CC=C1)C#CC1=CC=CC=C1
SPLASH splash10-0006-0904000000-b44e4f175eca43b11695
Source of Spectrum K1-2022-SM42-1s (DOI: 10.1002/ejoc.202200984)
Wiley ID 1898852